3-[bis(3-methylbutyl)amino]-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-[bis(3-methylbutyl)amino]-1H-pyrazole-5-carboxylic acid Openeye Name: 3-(diisopentylamino)-1H-pyrazole-5-carboxylic acid CAS Name: 3-[bis(3-methylbutyl)amino]-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-[bis(3-methylbutyl)amino]-1H-pyrazole-5-carboxylic acid Traditional Name: 3-(diisoamylamino)-1H-pyrazole-5-carboxylic acid Formula: C14H25N3O2 MolecularWeight: 267.3672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)C1=NNC(=C1)C(=O)O

Isomeric SMILES

CC(C)CCN(CCC(C)C)C1=NNC(=C1)C(=O)O

InChI

InChI=1S/C14H25N3O2/c1-10(2)5-7-17(8-6-11(3)4)13-9-12(14(18)19)15-16-13/h9-11H,5-8H2,1-4H3,(H,15,16)(H,18,19)